이름: 3-(3,5-difluorophenyl)-3-methoxy-1-(2,2,2-trifluoroethyl)pyrrolidine
SMILES:
COC1(c2cc(F)cc(F)c2)CCN(CC(F)(F)F)C1Molecular Processing
Molecular formula
C13H14F5NO
Molecular weight
295.25
Exact mass
295.0996
XLogP
3.07
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
62.16
Supplementary Information
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